[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxybutanoate

Systemtic Name: [2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxybutanoate Openeye Name: [2-[4-(cyanomethyl)anilino]-2-oxo-ethyl] (2R)-2-phenoxybutanoate CAS Name: (2R)-2-phenoxybutanoic acid [2-[4-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(cyanomethyl)anilino]-2-oxoethyl] (2R)-2-phenoxybutanoate Traditional Name: (2R)-2-phenoxybutyric acid [2-[4-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC(=O)NC1=CC=C(C=C1)CC#N)OC2=CC=CC=C2

Isomeric SMILES

CC[C@H](C(=O)OCC(=O)NC1=CC=C(C=C1)CC#N)OC2=CC=CC=C2

InChI

InChI=1S/C20H20N2O4/c1-2-18(26-17-6-4-3-5-7-17)20(24)25-14-19(23)22-16-10-8-15(9-11-16)12-13-21/h3-11,18H,2,12,14H2,1H3,(H,22,23)/t18-/m1/s1